Geometry & MOs

Info

ID:	265751
PubChem CID:	103544203
Reduced:	NSO2C10H15 (1)
Stoich.:	ABC2D10E15 (1)
Weight, g/mol:	235.075705
ΔH_f, kcal/mol:	-72.1
Dipole, Da:	2.82
IP(EA), eV:	-8.96(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 5-amino-1-(4-fluorophenyl)imidazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C=CS1)C(CC2OCCO2)N

DOS

IR

Vibrations